Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | AGER | Q15109 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1107770 | 0.82 | POLB (0.43) | POLBCA2PARP1NISCHBRD4 | |
| SCHEMBL8525523 | 0.82 | POLB (0.43) | POLBCA2PARP1NISCHBRD4 | |
| SCHEMBL23219954 | 0.71 | CA2 (0.34) | CA2NISCH | |
| Hydrochloric Acid SCHEMBL30630559 | 0.71 | ABCB1 (0.36) | POLBPARP1 | |
| SCHEMBL353825 | 0.71 | PARP1 (0.40) | POLBCA2PARP1NISCHBRD4 | |
| SCHEMBL30539313 | 0.71 | CA2 (0.40) | CA2NISCH | |
| SCHEMBL3205767 | 0.71 | CA2 (0.40) | CA2NISCH | |
| SCHEMBL15188492 | 0.70 | MAOB (0.39) | POLBPARP1KDM4E | |
| SCHEMBL9799367 | 0.69 | PARP1 (0.44) | PARP1NISCHBRD4CREBBPKDM4E | |
| SCHEMBL7313976 | 0.69 | AOC2 (0.41) | NISCHBRD4CREBBPHPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0429535-A1 | FUNGICIDAL BENZODIOXANE AMINE DERIVATIVES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1991-06-05 | — | — | EP | disclosed |
| EP-0359400-A1 | Fungicidal benzodioxane amine derivatives | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-03-21 | — | — | EP | disclosed |
| WO-1990002122-A1 | FUNGICIDAL BENZODIOXANE AMINE DERIVATIVES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-03-08 | — | — | WO | disclosed |